Vitas-M small molecule compound

{(2E)-2-[(2E)-(3-chloro-5-ethoxy-4-{[(4-methoxyphenyl)carbonyl]oxy}benzylidene)hydrazinylidene]-4-oxo-1,3-thiazolidin-5-yl}acetic acid

Catalog ID
STK022490
SMILES CCOc1cc(/C=N/N=C\2/SC(C(=O)N2)CC(=O)O)cc(c1OC(=O)c1ccc(cc1)OC)Cl

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C22H20ClN3O7S MW 505.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClN3O7S/c1-3-32-16-9-12(11-24-26-22-25-20(29)17(34-22)10-18(27)28)8-15(23)19(16)33-21(30)13-4-6-14(31-2)7-5-13/h4-9,11,17H,3,10H2,1-2H3,(H,27,28)(H,25,26,29)/b24-11+
InChIKey
BZFPBORMLJPUFE-BHGWPJFGSA-N
Synonyms

((2E)2((2E)(3CHLORO5ETHOXY4(((4METHOXYPHENYL)CARBONYL)OXY)BENZYLIDENE)HYDRAZINYLIDENE)4OXO13THIAZOLIDIN5YL)ACETICACID
2(2((2E)2((3chloro5ethoxy4(4methoxybenzoyl)oxyphenyl)methylidene)hydrazinyl)4oxo13thiazol5yl)aceticacid
CCOC1=C(C(=CC(=C1)C=NNC2=NC(=O)C(S2)CC(=O)O)Cl)OC(=O)C3=CC=C(C=C3)OC
CCOc1cc(C=NN=C2SC(C(=O)N2)CC(=O)O)cc(c1OC(=O)c1ccc(cc1)OC)Cl
InChI=1SC22H20ClN3O7Sc133216912(112426222520(29)17(3422)1018(27)28)815(23)19(16)3321(30)134614(312)7513h491117H310H212H3(H2728)(H252629)b2411+
MFCD08049911
STK022490
ZINC000013940447
ZINC000013940448

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Available files

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